2-(4-pyridin-2-ylbut-3-ynyl)isoindole-1,3-dione

Systemtic Name: 2-(4-pyridin-2-ylbut-3-ynyl)isoindole-1,3-dione Openeye Name: 2-[4-(2-pyridyl)but-3-ynyl]isoindoline-1,3-dione CAS Name: 2-[4-(2-pyridinyl)but-3-ynyl]isoindole-1,3-dione IUPAC Name: 2-(4-pyridin-2-ylbut-3-ynyl)isoindole-1,3-dione Traditional Name: 2-[4-(2-pyridyl)but-3-ynyl]isoindoline-1,3-quinone Formula: C17H12N2O2 MolecularWeight: 276.28938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC#CC3=CC=CC=N3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC#CC3=CC=CC=N3

InChI

InChI=1S/C17H12N2O2/c20-16-14-9-1-2-10-15(14)17(21)19(16)12-6-4-8-13-7-3-5-11-18-13/h1-3,5,7,9-11H,6,12H2